SCHEMBL8565268

SCHEMBL8565268

CCOC(=O)c1cnc2nc(C)c(OCC)cc2c1N(C)c1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.42
MAPT P10636 6/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
DHFR P00374 1/20 0.40
NPC1 O15118 1/20 0.39
MAOB P27338 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8559696 0.91 KDM4E (0.41) MAPTLMNAALDH1A1KDM4EHPGD
SCHEMBL9542072 0.88 PDE4B (0.43) MAPTLMNAALDH1A1NPSR1GAA
SCHEMBL8563378 0.80 PDE4B (0.59) MAPTALDH1A1NPSR1GAASMN1; SMN2
Hydrochloric Acid SCHEMBL811230 0.79 PDE4B (0.58) MAPTALDH1A1NPSR1GAASMN1; SMN2
SCHEMBL8322260 0.77 DPP4 (0.48) DPP4MAPTKDM4ENPSR1NPC1
SCHEMBL8562110 0.76 MAPT (0.56) MAPTLMNAALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL8566639 0.75 MAPT (0.55) MAPTLMNAALDH1A1KDM4EHPGD
SCHEMBL8327645 0.74 KMT2A (0.51) DPP4MAPTALDH1A1KDM4EHPGD
SCHEMBL8558688 0.74 PDE4B (0.60) MAPTALDH1A1NPSR1GAASMN1; SMN2
SCHEMBL8569260 0.74 PDE4B (0.56) MAPTLMNAALDH1A1NPSR1GAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0618916-B1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES KNOLL AG (DE) 1998-09-23 EP disclosed
US-5464781-A TREATING RHEUMATIC DISEASES THE BOOTS COMPANY PLC (GB) 1995-11-07 US disclosed
EP-0618916-A1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES Knoll AG (DE) 1994-10-12 EP disclosed
WO-1993013097-A1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed